SCHEMBL4138495

SCHEMBL4138495

Cc1ncc(-c2c(C)nc(-c3cccc(F)c3O)n(CCC3CCCCC3)c2=O)s1

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CASR P41180 12/20 0.70
NR1I2 O75469 5/20 0.54
GNRHR P30968 3/20 0.35
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
LMNA P02545 1/20 0.33
USP19 O94966 1/20 0.33
CDK9 P50750 1/20 0.32
DYRK1A Q13627 1/20 0.32
DYRK2 Q92630 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4140689 0.89 CASR (0.68) CASRNR1I2GNRHRCNR1CNR2
SCHEMBL4145492 0.84 CASR (0.51) CASRNR1I2GNRHRCNR1CNR2
SCHEMBL4149446 0.82 CASR (1.00) CASRNR1I2
SCHEMBL4142886 0.80 CASR (0.66) CASRNR1I2GNRHRCNR1CNR2
SCHEMBL3414739 0.78 CASR (0.90) CASRNR1I2
SCHEMBL3419297 0.76 CASR (0.85) CASRNR1I2
SCHEMBL3418007 0.75 CASR (0.84) CASRNR1I2
SCHEMBL4136034 0.74 CASR (0.85) CASRNR1I2
SCHEMBL13851662 0.74 CASR (0.59) CASRNR1I2GNRHR
SCHEMBL4144975 0.74 CASR (0.72) CASRNR1I2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090137557-A1 Calcilytic Compounds SMITHKLINE BEECHAM CORPORATION 2009-05-28 US claimed
US-20090137557-A1 Calcilytic Compounds SMITHKLINE BEECHAM CORPORATION 2009-05-28 US disclosed
US-20090137557-A1 Calcilytic Compounds SMITHKLINE BEECHAM CORPORATION 2009-05-28 US disclosed
US-20090137557-A1 Calcilytic Compounds SMITHKLINE BEECHAM CORPORATION 2009-05-28 US disclosed
WO-2007062370-A2 CALCILYTIC COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2007-05-31 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090137557-A1 Calcilytic Compounds CALCR, SOST, CALCB CASR 12/4885NR1I2 3373/4885GNRHR 2924/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.